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Updated: Aug 20, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on: April 12, 2019
A catalytic Langmuir film as a model for heterogeneous and homogeneous catalytic processes
Andrea Pasc-Banu1, Claudia Sugisaki, Thierry Gharsa
1Laboratoire des Interactions Moléculaires et Réactivités Chimique et Photochimique, CNRS UMR 5623, Université Paul Sabatier, 118 route de Narbonne, 31062 Toulouse Cedex 4, France.
No abstract available in PubMed .
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